TL;DR: o-Benzyl-DL-tyrosine (CAS 96612-91-8) is a chemical compound with molecular formula C16H17NO3 and molecular weight 271.12085 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-amino-3-(4-phenylmethoxyphenyl)propanoic acid
Also Known As: O-Benzyl-L-tyrosine, o-benzyl-d-tyrosine, O-benzyltyrosine, H-Tyr(Bzl)-Oh, O-Benzyl-dl-tyrosine
Top 5 of 11 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C16H17NO3 |
| Molecular Weight | 271.12085 g/mol |
| XLogP | -0.1 |
| Topological Polar Surface Area (TPSA) | 72.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 271.12085 Da |
| Heavy Atoms | 20 |
| Complexity | 294.0 |
| SMILES | C1=CC=C(C=C1)COC2=CC=C(C=C2)CC(C(=O)O)N |
| InChIKey | KAFHLONDOVSENM-UHFFFAOYSA-N |
The XLogP value of -0.1 indicates that o-Benzyl-DL-tyrosine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 72.6 Ų falls within the moderate polarity range, balancing permeability and solubility for o-Benzyl-DL-tyrosine. Following Lipinski's Rule of Five, o-Benzyl-DL-tyrosine has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of o-Benzyl-DL-tyrosine is 96612-91-8.
The molecular formula of o-Benzyl-DL-tyrosine is C16H17NO3.
The molecular weight of o-Benzyl-DL-tyrosine is 271.12085 g/mol.
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